几种新型含噻唑烷衍生物的合成、表征及对接研究

Navneet P. Mori, Priti K. Parmar, Vijay M. Khedker, Gaurav Sanghavi, R. Khunt
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引用次数: 0

摘要

噻唑衍生物是药物开发的潜在候选者。它们可以有效地合成,并且对几种疾病非常活跃,包括抗菌筛选。2-(2-(3-甲氧基-4-(pro- 2-yn-1-yloxy)苄基)肼基)-4-(对甲苯基)-4,5-二氢噻唑(5a-f)和2-(2-(4-(4-溴苯基)-噻唑-2-基)肼基)甲基)-5-(二乙基氨基)苯酚(8g-j)通过质谱、FT-IR、1H和13CNMR等光谱分析对合成的化合物进行了表征。所有合成的化合物对革兰氏阳性(金黄色葡萄球菌、化脓性链球菌)和革兰氏阴性(大肠杆菌、克雷伯氏菌)的体外抗菌活性进行了筛选。具有药理效力的噻唑衍生物在治疗微生物疾病,特别是对抗细菌和真菌感染方面提供了有价值的治疗参与。此外,为了弄清它们貌似合理的作用机制和控制这些分子结合的热力学相互作用,对细菌DNA的关键靶标Gyrase进行了分子对接研究。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Synthesis, Characterization and Docking Studies of Some New Alkyne Containing Thiazole Derivatives
Thiazole derivatives are potential candidates for drug development. They can be efficiently synthesized and are extremely active against several diseases, including antimicrobial screening. A series of 2-(2-(3-methoxy-4-(prop-2-yn-1-yloxy)benzylidene)hydrazinyl)-4-(p-tolyl)-4,5-dihydrothiazole (5a-f) and 2-((2-(4-(4-bromophenyl)-thiazol-2-yl)hydrazono)methyl)-5-(diethylamino)phenol (8g-j). The synthesized compounds’ have been characterized by spectral analysis, such as mass, FT-IR, 1H & 13C NMR. All the synthesized compounds were screened for in vitro antibacterial activity against some Gram-positive (Staphylococcus aureus, Streptococcus pyogenes) and Gram-negative (Escherichia coli, Klebsila) bacteria. The thiazole derivatives with a pharmacologically potent group provide the valued therapeutic involvement in the treatment of microbial diseases, especially against bacterial and fungal infections. Furthermore, to gauze their plausible mechanism of action and thermodynamic interaction governing these molecules’ binding, a molecular docking study was carried out against crucial target bacterial DNA, Gyrase.
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